#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1q86 s HIS 2 N 0.00 2.64 -0.27 1.12 3.76 0.61 -4.42 115.29 118.73 1q86 s HIS 2 Ca 0.00 -0.23 -0.10 0.00 -0.15 0.00 0.00 55.06 54.58 1q86 s HIS 2 Cb 0.00 -1.22 -0.04 0.00 1.11 0.00 0.00 32.58 32.43 1q86 s HIS 2 CO 0.00 0.58 0.15 0.00 -0.85 0.00 0.00 174.74 174.62 1q86 s ALA 3 N -2.07 3.41 -0.18 -1.40 0.00 0.26 -0.47 121.76 121.31 1q86 s ALA 3 Ca 0.28 -1.11 -0.08 0.00 0.00 0.00 0.00 51.96 51.05 1q86 s ALA 3 Cb -0.07 -2.35 -0.04 0.00 0.00 0.00 0.00 23.12 20.65 1q86 s ALA 3 CO 0.17 -0.55 0.08 -0.51 0.00 0.00 0.00 175.76 174.96 1q86 s LEU 4 N 1.71 3.93 -0.09 0.00 1.43 0.15 -3.01 118.68 122.80 1q86 s LEU 4 Ca 0.07 0.14 -0.01 0.00 -1.03 0.00 0.00 54.13 53.29 1q86 s LEU 4 Cb -0.16 -1.99 0.03 0.00 0.03 0.00 0.00 46.19 44.09 1q86 s LEU 4 CO 0.09 0.19 -0.03 -0.69 0.23 0.00 0.00 176.35 176.14 1q86 s VAL 5 N 0.27 0.64 -0.05 -1.59 1.01 -0.07 -0.52 120.40 120.09 1q86 s VAL 5 Ca 0.05 -0.05 -0.30 0.00 0.00 0.00 0.00 61.98 61.68 1q86 s VAL 5 Cb -0.12 -0.74 -0.03 0.00 0.00 0.00 0.00 36.38 35.49 1q86 s VAL 5 CO -0.00 0.30 1.21 -1.58 0.00 0.00 0.00 175.10 175.03 1q86 s GLN 6 N 1.82 4.35 0.00 2.72 0.74 -0.99 -0.33 119.66 127.97 1q86 s GLN 6 Ca 0.04 1.70 0.06 0.00 0.05 0.00 0.00 55.36 57.21 1q86 s GLN 6 Cb -0.12 -3.55 -0.04 0.00 1.10 0.00 0.00 33.01 30.39 1q86 s GLN 6 CO -0.06 -0.45 0.32 1.28 -0.55 0.00 0.00 175.29 175.83 1q86 n LEU 7 N 5.18 0.49 -4.15 3.68 4.77 -0.55 -0.60 117.00 125.83 1q86 n LEU 7 Ca 0.11 -0.59 -0.26 0.00 -0.03 0.00 0.00 56.01 55.25 1q86 n LEU 7 Cb 0.46 0.00 -0.16 0.00 -2.33 0.00 0.00 43.42 41.39 1q86 n LEU 7 CO 0.55 0.11 -0.50 -0.13 -1.33 0.00 0.00 177.39 176.09 1q86 s ARG 8 N -1.37 1.62 1.27 3.23 0.52 -1.12 -4.93 118.95 118.19 1q86 s ARG 8 Ca 0.03 -0.62 -0.19 0.00 -0.52 0.00 0.00 55.73 54.43 1q86 s ARG 8 Cb 0.04 -1.47 0.29 0.00 0.52 0.00 0.00 34.95 34.33 1q86 s ARG 8 CO 0.21 0.30 0.66 0.41 0.02 0.00 0.00 175.30 176.90 1q86 n GLY 9 N 2.93 -3.19 0.08 -3.53 0.00 -1.26 -4.87 105.19 95.34 1q86 n GLY 9 Ca -0.17 -1.31 -0.08 0.00 0.00 0.00 0.00 46.02 44.46 1q86 n GLY 9 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1q86 h GLU 10 N -3.18 0.00 -6.45 1.61 4.11 -1.99 -3.44 114.58 105.25 1q86 h GLU 10 Ca -0.37 0.00 -0.60 0.00 0.07 0.00 0.00 59.36 58.46 1q86 h GLU 10 Cb 1.12 0.00 0.06 0.00 0.50 0.00 0.00 28.75 30.43 1q86 h GLU 10 CO 0.23 0.52 0.75 0.28 0.07 0.00 0.00 179.01 180.86 1q86 n VAL 11 N -3.06 0.03 0.00 -1.06 0.31 -1.26 -1.48 118.33 111.80 1q86 n VAL 11 Ca -0.16 -0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.17 1q86 n VAL 11 Cb 1.04 -1.41 0.00 0.00 -0.91 0.00 0.00 33.84 32.56 1q86 n VAL 11 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 1q86 n ASN 12 N 3.39 0.00 -4.74 4.52 3.02 -1.26 -4.99 115.26 115.21 1q86 n ASN 12 Ca 0.18 0.00 -0.41 0.00 -0.03 0.00 0.00 54.58 54.32 1q86 n ASN 12 Cb 0.27 -0.40 -0.04 0.00 -0.61 0.00 0.00 39.78 39.00 1q86 n ASN 12 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1q86 s MET 13 N 0.00 4.67 0.36 3.52 0.23 -0.55 -4.95 119.30 122.58 1q86 s MET 13 Ca 0.00 1.58 -0.23 0.00 -1.03 0.00 0.00 55.69 56.00 1q86 s MET 13 Cb 0.00 -3.32 -0.15 0.00 -1.53 0.00 0.00 34.83 29.83 1q86 s MET 13 CO 0.00 0.19 0.38 0.72 -2.03 0.00 0.00 175.02 174.29 1q86 n HIS 14 N 2.40 -1.04 -0.09 3.16 8.25 -1.26 -4.72 115.22 121.92 1q86 n HIS 14 Ca 0.02 0.70 -0.13 0.00 -0.26 0.00 0.00 57.72 58.05 1q86 n HIS 14 Cb 0.47 -1.91 -0.04 0.00 1.12 0.00 0.00 29.99 29.63 1q86 n HIS 14 CO 0.00 0.00 0.00 1.15 0.64 0.00 0.00 176.34 178.13 1q86 h THR 15 N 0.72 1.30 0.00 1.59 2.02 -1.96 -1.27 112.91 115.32 1q86 h THR 15 Ca -0.36 -1.41 -0.00 0.00 0.77 0.00 0.00 66.41 65.41 1q86 h THR 15 Cb 1.42 1.59 -0.00 0.00 -1.74 0.00 0.00 68.15 69.42 1q86 h THR 15 CO 0.51 0.45 -0.00 -2.24 0.37 0.00 0.00 175.52 174.61 1q86 h ASP 16 N 0.40 0.00 0.00 4.18 2.03 -1.99 0.41 116.42 121.45 1q86 h ASP 16 Ca 0.05 0.00 -0.10 0.00 -0.73 0.00 0.00 57.03 56.24 1q86 h ASP 16 Cb 0.81 0.00 -0.02 0.00 -0.83 0.00 0.00 39.33 39.30 1q86 h ASP 16 CO 0.06 0.00 -0.56 0.40 -1.03 0.00 0.00 179.24 178.11 1q86 h ILE 17 N 0.00 1.38 -0.73 4.15 2.04 -1.85 -3.20 117.51 119.29 1q86 h ILE 17 Ca -0.00 -2.25 0.07 0.00 1.00 0.00 0.00 64.86 63.68 1q86 h ILE 17 Cb 0.11 2.82 -0.06 0.00 -0.74 0.00 0.00 36.82 38.95 1q86 h ILE 17 CO 0.00 0.47 0.41 -0.61 0.00 0.00 0.00 178.15 178.41 1q86 h GLN 18 N -1.00 0.70 -0.45 2.37 4.15 -0.22 -0.29 115.11 120.37 1q86 h GLN 18 Ca -0.16 -0.04 -0.01 0.00 0.77 0.00 0.00 58.65 59.21 1q86 h GLN 18 Cb 1.12 -0.16 -0.02 0.00 0.21 0.00 0.00 27.48 28.63 1q86 h GLN 18 CO -0.09 0.46 0.25 -0.44 -1.93 0.00 0.00 178.83 177.08 1q86 h ASP 19 N 0.72 0.55 -0.18 -0.69 3.32 -0.36 -1.32 116.42 118.46 1q86 h ASP 19 Ca 0.34 -0.03 -0.03 0.00 0.02 0.00 0.00 57.03 57.33 1q86 h ASP 19 Cb 0.26 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.67 1q86 h ASP 19 CO -0.21 0.44 0.00 0.74 -1.72 0.00 0.00 179.24 178.49 1q86 h THR 20 N 0.63 1.25 -0.65 0.35 2.02 -1.07 0.11 112.91 115.54 1q86 h THR 20 Ca 0.16 -0.85 0.10 0.00 0.77 0.00 0.00 66.41 66.59 1q86 h THR 20 Cb 0.02 1.46 -0.04 0.00 -1.74 0.00 0.00 68.15 67.84 1q86 h THR 20 CO -0.03 0.26 0.44 -0.07 0.37 0.00 0.00 175.52 176.49 1q86 h LEU 21 N 0.07 0.46 -0.48 2.58 3.38 -0.85 0.24 115.31 120.70 1q86 h LEU 21 Ca 0.05 0.01 -0.17 0.00 0.09 0.00 0.00 57.88 57.86 1q86 h LEU 21 Cb 0.38 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 1q86 h LEU 21 CO 0.01 0.28 -0.60 -0.33 0.09 0.00 0.00 178.44 177.88 1q86 h GLU 22 N 0.51 0.52 0.00 1.13 5.08 -0.56 0.82 114.58 122.08 1q86 h GLU 22 Ca 0.30 -0.35 -0.07 0.00 -1.00 0.00 0.00 59.36 58.23 1q86 h GLU 22 Cb 0.50 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.79 1q86 h GLU 22 CO -0.09 0.97 -0.35 0.52 -1.00 0.00 0.00 179.01 179.05 1q86 h MET 23 N 0.39 0.00 -0.89 2.33 2.86 0.11 -1.72 114.93 118.00 1q86 h MET 23 Ca -0.00 0.00 -0.09 0.00 -2.06 0.00 0.00 59.70 57.54 1q86 h MET 23 Cb 1.16 0.00 -0.05 0.00 0.06 0.00 0.00 31.60 32.76 1q86 h MET 23 CO 0.11 0.35 0.12 1.28 1.06 0.00 0.00 176.91 179.83 1q86 n LEU 24 N -3.70 3.70 -1.87 1.22 4.77 -0.17 -4.88 117.00 116.07 1q86 n LEU 24 Ca -0.01 -1.90 -0.20 0.00 -0.03 0.00 0.00 56.01 53.87 1q86 n LEU 24 Cb 0.45 -0.61 -0.06 0.00 -2.33 0.00 0.00 43.42 40.87 1q86 n LEU 24 CO 0.36 0.55 -0.21 0.59 -1.33 0.00 0.00 177.39 177.35 1q86 n ASN 25 N 0.07 -5.46 -4.36 -1.43 3.02 -0.65 -4.85 115.26 101.61 1q86 n ASN 25 Ca 0.18 0.33 -0.34 0.00 -0.03 0.00 0.00 54.58 54.72 1q86 n ASN 25 Cb 0.80 -4.73 -0.14 0.00 -0.61 0.00 0.00 39.78 35.10 1q86 n ASN 25 CO 0.00 0.00 0.00 0.27 -2.62 0.00 0.00 177.26 174.91 1q86 s ILE 26 N -2.81 3.22 0.00 2.41 -4.36 0.25 -4.72 121.20 115.19 1q86 s ILE 26 Ca 0.00 -0.58 0.00 0.00 -0.26 0.00 0.00 60.65 59.81 1q86 s ILE 26 Cb 0.00 -2.40 0.00 0.00 1.25 0.00 0.00 42.46 41.31 1q86 s ILE 26 CO 0.00 0.49 0.74 1.41 0.24 0.00 0.00 174.94 177.82 1q86 n HIS 27 N 3.98 0.00 -3.73 1.37 8.25 -1.26 -3.46 115.22 120.37 1q86 n HIS 27 Ca -0.18 -0.26 -0.12 0.00 -0.26 0.00 0.00 57.72 56.90 1q86 n HIS 27 Cb 0.52 -0.03 -0.07 0.00 1.12 0.00 0.00 29.99 31.53 1q86 n HIS 27 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 1q86 s HIS 28 N -0.53 -0.14 0.44 4.41 3.76 -1.26 -5.10 115.29 116.88 1q86 s HIS 28 Ca 0.00 -0.00 -0.25 0.00 -0.15 0.00 0.00 55.06 54.66 1q86 s HIS 28 Cb 0.00 0.13 -0.08 0.00 1.11 0.00 0.00 32.58 33.74 1q86 s HIS 28 CO 0.00 -0.53 1.28 0.08 -0.85 0.00 0.00 174.74 174.72 1q86 s VAL 29 N -2.66 2.63 0.00 -0.90 1.01 -1.26 -2.39 120.40 116.84 1q86 s VAL 29 Ca -0.04 0.53 0.00 0.00 0.00 0.00 0.00 61.98 62.47 1q86 s VAL 29 Cb -0.00 -3.30 0.00 0.00 0.00 0.00 0.00 36.38 33.08 1q86 s VAL 29 CO -0.04 0.05 0.00 0.59 0.00 0.00 0.00 175.10 175.70 1q86 n ASN 30 N -0.20 -1.49 -4.80 3.32 3.02 0.24 -4.99 115.26 110.35 1q86 n ASN 30 Ca 0.06 0.00 -0.39 0.00 -0.03 0.00 0.00 54.58 54.22 1q86 n ASN 30 Cb 0.45 -0.45 -0.06 0.00 -0.61 0.00 0.00 39.78 39.11 1q86 n ASN 30 CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 1q86 s HIS 31 N -2.92 3.84 0.07 3.10 3.76 -1.00 -2.46 115.29 119.68 1q86 s HIS 31 Ca 0.00 1.41 0.09 0.00 -0.15 0.00 0.00 55.06 56.41 1q86 s HIS 31 Cb 0.00 -2.60 -0.03 0.00 1.11 0.00 0.00 32.58 31.06 1q86 s HIS 31 CO 0.00 0.55 -0.25 0.00 -0.85 0.00 0.00 174.74 174.19 1q86 s THR 33 N -0.90 0.64 -0.25 0.00 -1.32 0.32 0.52 115.64 114.66 1q86 s THR 33 Ca 0.11 -1.96 -0.02 0.00 -1.21 0.00 0.00 61.69 58.61 1q86 s THR 33 Cb -0.10 -1.94 0.02 0.00 -1.51 0.00 0.00 72.50 68.97 1q86 s THR 33 CO 0.03 -0.63 -0.04 -0.76 -2.21 0.00 0.00 174.62 171.01 1q86 s LEU 34 N -3.11 3.27 -0.09 9.08 1.43 -1.26 0.30 118.68 128.30 1q86 s LEU 34 Ca 0.19 -0.82 0.05 0.00 -1.03 0.00 0.00 54.13 52.51 1q86 s LEU 34 Cb 0.06 -1.70 -0.00 0.00 0.03 0.00 0.00 46.19 44.58 1q86 s LEU 34 CO 0.00 -0.13 -0.24 0.54 0.23 0.00 0.00 176.35 176.75 1q86 s VAL 35 N 1.36 2.06 0.71 -1.59 0.11 0.38 -4.95 120.40 118.48 1q86 s VAL 35 Ca 0.01 -1.03 -0.16 0.00 -2.93 0.00 0.00 61.98 57.86 1q86 s VAL 35 Cb -0.17 -1.77 0.03 0.00 -1.53 0.00 0.00 36.38 32.94 1q86 s VAL 35 CO -0.03 0.56 1.25 -2.84 -3.33 0.00 0.00 175.10 170.71 1q86 s PRO 36 N 0.16 2.20 -0.76 1.54 0.02 -1.26 -0.29 135.00 136.61 1q86 s PRO 36 Ca -0.14 1.92 -0.18 0.00 0.02 0.00 0.00 61.00 62.63 1q86 s PRO 36 Cb -0.17 -1.82 0.14 0.00 0.02 0.00 0.00 34.50 32.67 1q86 s PRO 36 CO 0.07 -1.83 0.87 -1.21 -0.33 0.00 0.00 177.00 174.57 1q86 s GLU 37 N -3.70 3.36 0.42 5.54 2.02 -1.26 -4.73 118.70 120.35 1q86 s GLU 37 Ca 0.78 -1.71 0.04 0.00 0.02 0.00 0.00 54.97 54.10 1q86 s GLU 37 Cb -0.33 -4.52 -0.05 0.00 0.10 0.00 0.00 34.13 29.33 1q86 s GLU 37 CO 0.44 -1.57 0.04 0.99 0.02 0.00 0.00 175.26 175.18 1q86 s THR 38 N 2.15 1.31 0.02 3.63 2.01 -1.26 -4.89 115.64 118.61 1q86 s THR 38 Ca 0.20 -2.00 -0.23 0.00 0.31 0.00 0.00 61.69 59.98 1q86 s THR 38 Cb -0.14 -2.60 -0.16 0.00 0.01 0.00 0.00 72.50 69.61 1q86 s THR 38 CO -0.02 0.00 1.35 0.44 -0.69 0.00 0.00 174.62 175.70 1q86 h ASP 39 N 1.74 0.21 -0.22 3.53 3.32 -1.99 0.83 116.42 123.85 1q86 h ASP 39 Ca -0.42 -0.44 0.02 0.00 0.02 0.00 0.00 57.03 56.22 1q86 h ASP 39 Cb 1.27 -0.06 -0.02 0.00 0.22 0.00 0.00 39.33 40.74 1q86 h ASP 39 CO 0.72 0.60 0.07 0.00 -1.72 0.00 0.00 179.24 178.91 1q86 h ALA 40 N 0.61 0.24 0.00 3.45 0.00 -1.98 -1.71 119.26 119.88 1q86 h ALA 40 Ca 0.02 0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.88 1q86 h ALA 40 Cb 0.53 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 1q86 h ALA 40 CO 0.02 -0.34 -0.34 1.88 0.00 0.00 0.00 179.25 180.46 1q86 h TYR 41 N 0.18 0.00 0.10 0.00 -1.99 -1.84 -3.03 116.97 110.39 1q86 h TYR 41 Ca 0.10 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.82 1q86 h TYR 41 Cb 0.06 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.79 1q86 h TYR 41 CO -0.12 0.34 -0.05 -0.09 -0.00 0.00 0.00 178.16 178.24 1q86 h ARG 42 N 0.00 -0.13 -0.85 4.88 2.43 -0.17 -2.62 114.38 117.91 1q86 h ARG 42 Ca -0.00 0.01 0.16 0.00 -0.81 0.00 0.00 59.98 59.34 1q86 h ARG 42 Cb 0.76 0.03 -0.10 0.00 -0.42 0.00 0.00 29.97 30.24 1q86 h ARG 42 CO 0.04 0.19 0.42 0.78 -1.51 0.00 0.00 179.97 179.89 1q86 h GLY 43 N -0.47 1.39 0.85 2.80 0.00 -1.26 -1.60 103.07 104.78 1q86 h GLY 43 Ca -0.01 -0.22 -0.01 0.00 0.00 0.00 0.00 47.33 47.08 1q86 h GLY 43 CO 0.02 -0.09 0.05 -0.33 0.00 0.00 0.00 176.54 176.19 1q86 h MET 44 N 0.56 0.20 0.00 4.80 2.86 -1.42 -2.61 114.93 119.32 1q86 h MET 44 Ca 0.48 -0.04 -0.06 0.00 -2.06 0.00 0.00 59.70 58.02 1q86 h MET 44 Cb 0.74 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 32.36 1q86 h MET 44 CO -0.40 0.32 -0.29 -0.39 1.06 0.00 0.00 176.91 177.21 1q86 h VAL 45 N 0.04 1.10 -0.58 -2.22 -1.51 -1.02 -2.29 116.25 109.77 1q86 h VAL 45 Ca 0.04 -1.04 -0.10 0.00 -1.23 0.00 0.00 66.70 64.36 1q86 h VAL 45 Cb 0.20 1.58 -0.02 0.00 -2.13 0.00 0.00 31.29 30.92 1q86 h VAL 45 CO -0.00 0.29 -0.05 0.00 -1.23 0.00 0.00 177.57 176.58 1q86 h ALA 46 N 1.71 0.81 0.00 5.19 0.00 -1.17 0.28 119.26 126.07 1q86 h ALA 46 Ca -0.00 -0.33 -0.07 0.00 0.00 0.00 0.00 54.91 54.50 1q86 h ALA 46 Cb 0.56 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1q86 h ALA 46 CO 0.04 0.67 -0.34 -0.22 0.00 0.00 0.00 179.25 179.40 1q86 h LYS 47 N 0.95 0.00 0.00 0.00 3.64 -1.05 -2.54 116.57 117.56 1q86 h LYS 47 Ca 0.16 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.54 1q86 h LYS 47 Cb 0.61 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.43 1q86 h LYS 47 CO 0.04 0.34 -0.85 0.28 -2.27 0.00 0.00 179.45 176.99 1q86 n VAL 48 N -3.96 0.11 -0.22 2.00 0.31 -0.91 -4.62 118.33 111.04 1q86 n VAL 48 Ca -0.02 -0.14 0.21 0.00 -0.01 0.00 0.00 64.34 64.38 1q86 n VAL 48 Cb 0.40 0.31 0.37 0.00 -0.91 0.00 0.00 33.84 34.00 1q86 n VAL 48 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 1q86 n ASN 49 N -1.78 0.17 -0.31 4.52 2.85 0.94 -1.00 115.26 120.65 1q86 n ASN 49 Ca 0.03 0.91 0.14 0.00 -0.11 0.00 0.00 54.58 55.56 1q86 n ASN 49 Cb 0.39 -0.45 0.64 0.00 1.24 0.00 0.00 39.78 41.61 1q86 n ASN 49 CO 0.00 0.00 0.00 0.47 -2.11 0.00 0.00 177.26 175.62 1q86 n ASP 50 N -4.14 0.95 -0.19 1.20 8.00 -1.26 -3.16 116.55 117.95 1q86 n ASP 50 Ca 0.23 -1.36 0.02 0.00 0.71 0.00 0.00 54.79 54.39 1q86 n ASP 50 Cb 0.82 -0.01 0.03 0.00 -0.02 0.00 0.00 41.12 41.94 1q86 n ASP 50 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1q86 n PHE 51 N -0.24 0.00 -4.37 1.24 3.01 -0.17 -4.95 117.46 111.98 1q86 n PHE 51 Ca 0.20 -0.31 -0.22 0.00 1.01 0.00 0.00 57.45 58.13 1q86 n PHE 51 Cb 0.26 -0.06 -0.08 0.00 -0.01 0.00 0.00 39.48 39.59 1q86 n PHE 51 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 1q86 s VAL 52 N -0.82 0.21 -0.04 -4.37 0.11 -1.21 -1.48 120.40 112.81 1q86 s VAL 52 Ca 0.07 -2.00 -0.01 0.00 -2.93 0.00 0.00 61.98 57.12 1q86 s VAL 52 Cb 0.06 -2.43 0.03 0.00 -1.53 0.00 0.00 36.38 32.51 1q86 s VAL 52 CO 0.01 0.00 0.02 0.00 -3.33 0.00 0.00 175.10 171.80 1q86 s ALA 53 N -3.36 0.33 0.19 1.54 0.00 0.55 -1.92 121.76 119.10 1q86 s ALA 53 Ca 0.34 0.14 -0.05 0.00 0.00 0.00 0.00 51.96 52.38 1q86 s ALA 53 Cb 0.02 -0.46 -0.03 0.00 0.00 0.00 0.00 23.12 22.66 1q86 s ALA 53 CO 0.22 -0.24 0.23 -0.59 0.00 0.00 0.00 175.76 175.38 1q86 s PHE 54 N 1.47 0.78 0.00 0.00 -0.12 -0.92 -0.89 117.98 118.31 1q86 s PHE 54 Ca -0.04 -1.08 0.00 0.00 -0.05 0.00 0.00 56.93 55.76 1q86 s PHE 54 Cb -0.13 -0.27 0.00 0.00 -0.63 0.00 0.00 43.02 41.99 1q86 s PHE 54 CO -0.03 -0.72 0.00 0.41 -0.05 0.00 0.00 175.22 174.83 1q86 n GLY 55 N -0.26 -0.38 3.58 1.99 0.00 -1.16 0.51 105.19 109.48 1q86 n GLY 55 Ca -0.02 -1.28 -0.39 0.00 0.00 0.00 0.00 46.02 44.33 1q86 n GLY 55 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1q86 s GLU 56 N -2.00 3.87 0.55 1.61 2.12 -1.26 0.93 118.70 124.52 1q86 s GLU 56 Ca 0.00 -0.21 -0.14 0.00 0.36 0.00 0.00 54.97 54.98 1q86 s GLU 56 Cb 0.00 -3.70 -0.06 0.00 0.26 0.00 0.00 34.13 30.63 1q86 s GLU 56 CO 0.00 -0.31 0.99 -1.25 -0.54 0.00 0.00 175.26 174.15 1q86 s PRO 57 N 1.95 3.82 0.49 4.30 0.04 -1.26 -4.20 135.00 140.13 1q86 s PRO 57 Ca 0.11 0.87 -0.16 0.00 0.04 0.00 0.00 61.00 61.86 1q86 s PRO 57 Cb -0.16 -2.12 -0.08 0.00 0.04 0.00 0.00 34.50 32.17 1q86 s PRO 57 CO 0.11 -0.37 0.95 -1.54 0.04 0.00 0.00 177.00 176.19 1q86 s SER 58 N -3.47 6.66 0.17 6.66 1.04 -1.26 -4.85 113.70 118.65 1q86 s SER 58 Ca 0.57 1.53 -0.26 0.00 0.48 0.00 0.00 55.95 58.27 1q86 s SER 58 Cb -0.10 -2.49 0.03 0.00 0.10 0.00 0.00 66.02 63.56 1q86 s SER 58 CO 0.39 -0.53 1.55 -0.61 0.98 0.00 0.00 173.24 175.03 1q86 h GLN 59 N 1.12 -0.13 -0.25 4.02 5.75 -1.98 -0.99 115.11 122.64 1q86 h GLN 59 Ca -0.47 0.01 0.06 0.00 -0.15 0.00 0.00 58.65 58.09 1q86 h GLN 59 Cb 1.18 0.03 -0.06 0.00 1.07 0.00 0.00 27.48 29.71 1q86 h GLN 59 CO 0.62 -0.09 -0.11 0.93 -2.65 0.00 0.00 178.83 177.53 1q86 h GLU 60 N -0.14 -0.07 -0.08 1.69 5.08 -1.99 -0.97 114.58 118.10 1q86 h GLU 60 Ca 0.20 0.01 0.03 0.00 -1.00 0.00 0.00 59.36 58.59 1q86 h GLU 60 Cb 0.53 0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.77 1q86 h GLU 60 CO -0.81 -0.05 -0.10 1.15 -1.00 0.00 0.00 179.01 178.20 1q86 h THR 61 N -0.08 0.73 -0.68 1.13 2.02 -1.74 0.24 112.91 114.54 1q86 h THR 61 Ca 0.13 0.00 0.10 0.00 0.77 0.00 0.00 66.41 67.41 1q86 h THR 61 Cb 0.28 0.73 -0.07 0.00 -1.74 0.00 0.00 68.15 67.35 1q86 h THR 61 CO -0.30 0.00 0.30 0.25 0.37 0.00 0.00 175.52 176.14 1q86 h LEU 62 N -0.13 0.35 -0.02 2.58 5.85 -0.85 -0.73 115.31 122.37 1q86 h LEU 62 Ca 0.06 0.07 0.01 0.00 0.84 0.00 0.00 57.88 58.87 1q86 h LEU 62 Cb 0.22 0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.26 1q86 h LEU 62 CO -0.16 0.19 -0.06 -0.33 -0.34 0.00 0.00 178.44 177.75 1q86 h GLU 63 N 0.51 -0.09 -0.06 1.25 5.08 -0.09 0.29 114.58 121.47 1q86 h GLU 63 Ca 0.34 0.01 0.04 0.00 -1.00 0.00 0.00 59.36 58.75 1q86 h GLU 63 Cb 0.41 0.02 -0.05 0.00 0.50 0.00 0.00 28.75 29.64 1q86 h GLU 63 CO -0.30 -0.06 -0.20 1.15 -1.00 0.00 0.00 179.01 178.60 1q86 h THR 64 N -0.09 0.51 0.26 1.13 2.02 0.47 0.86 112.91 118.07 1q86 h THR 64 Ca 0.03 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.20 1q86 h THR 64 Cb 0.13 0.51 -0.01 0.00 -1.74 0.00 0.00 68.15 67.05 1q86 h THR 64 CO -0.07 0.00 -0.18 0.58 0.37 0.00 0.00 175.52 176.22 1q86 h VAL 65 N -0.29 0.62 -0.59 3.16 2.07 -0.99 0.23 116.25 120.47 1q86 h VAL 65 Ca 0.08 0.00 0.12 0.00 0.82 0.00 0.00 66.70 67.72 1q86 h VAL 65 Cb 0.40 0.62 -0.10 0.00 -1.52 0.00 0.00 31.29 30.69 1q86 h VAL 65 CO -0.23 0.00 -0.01 -0.07 0.02 0.00 0.00 177.57 177.28 1q86 h LEU 66 N -0.43 -0.28 -0.00 2.57 3.38 -0.12 1.69 115.31 122.12 1q86 h LEU 66 Ca -0.02 0.15 -0.00 0.00 0.09 0.00 0.00 57.88 58.09 1q86 h LEU 66 Cb 0.37 0.26 -0.00 0.00 0.09 0.00 0.00 40.66 41.38 1q86 h LEU 66 CO 0.01 -0.11 0.00 0.00 0.09 0.00 0.00 178.44 178.43 1q86 h ALA 67 N 1.54 0.00 -0.03 1.53 0.00 -0.53 -0.79 119.26 120.98 1q86 h ALA 67 Ca 0.30 -0.05 -0.17 0.00 0.00 0.00 0.00 54.91 54.99 1q86 h ALA 67 Cb 0.48 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 1q86 h ALA 67 CO -0.51 -0.45 -0.74 0.00 0.00 0.00 0.00 179.25 177.55 1q86 h THR 68 N -0.10 1.45 0.00 0.00 1.03 0.82 -3.40 112.91 112.72 1q86 h THR 68 Ca 0.00 -2.33 0.00 0.00 -0.01 0.00 0.00 66.41 64.07 1q86 h THR 68 Cb 0.10 2.25 0.00 0.00 -1.07 0.00 0.00 68.15 69.44 1q86 h THR 68 CO -0.00 0.68 -0.11 0.54 -0.01 0.00 0.00 175.52 176.62 1q86 n ARG 69 N -3.75 1.20 -2.96 0.00 5.12 0.56 -5.06 116.66 111.78 1q86 n ARG 69 Ca -0.03 -1.46 -0.32 0.00 -1.93 0.00 0.00 57.85 54.11 1q86 n ARG 69 Cb 0.71 -0.92 -0.05 0.00 -1.16 0.00 0.00 32.46 31.04 1q86 n ARG 69 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1q86 s ALA 70 N -1.07 3.25 0.02 7.54 0.00 -0.31 -4.15 121.76 127.05 1q86 s ALA 70 Ca 0.09 0.07 -0.00 0.00 0.00 0.00 0.00 51.96 52.11 1q86 s ALA 70 Cb 0.08 -2.85 -0.02 0.00 0.00 0.00 0.00 23.12 20.32 1q86 s ALA 70 CO 0.01 0.18 -0.03 -1.21 0.00 0.00 0.00 175.76 174.71 1q86 s GLU 71 N -3.29 0.37 0.96 0.00 2.02 -1.26 -4.13 118.70 113.36 1q86 s GLU 71 Ca 0.55 -0.71 -0.11 0.00 0.02 0.00 0.00 54.97 54.72 1q86 s GLU 71 Cb -0.10 0.13 0.17 0.00 0.10 0.00 0.00 34.13 34.43 1q86 s GLU 71 CO 0.21 -0.06 1.09 -2.14 0.02 0.00 0.00 175.26 174.37 1q86 s PRO 72 N -1.87 0.67 0.47 0.39 0.02 -1.26 -0.51 135.00 132.91 1q86 s PRO 72 Ca -0.12 1.05 0.29 0.00 0.02 0.00 0.00 61.00 62.24 1q86 s PRO 72 Cb -0.07 -1.72 1.58 0.00 0.02 0.00 0.00 34.50 34.31 1q86 s PRO 72 CO -0.02 -2.71 1.88 1.25 -0.33 0.00 0.00 177.00 177.06 1q86 h LEU 73 N -1.90 0.00 -7.13 -5.54 5.85 -1.47 -3.30 115.31 101.83 1q86 h LEU 73 Ca -0.50 0.00 -0.07 0.00 0.84 0.00 0.00 57.88 58.14 1q86 h LEU 73 Cb 1.29 0.00 -0.22 0.00 0.37 0.00 0.00 40.66 42.10 1q86 h LEU 73 CO 0.50 0.00 -0.02 -1.61 -0.34 0.00 0.00 178.44 176.96 1q86 s GLU 74 N -3.77 0.69 0.00 1.25 2.02 -1.26 -4.81 118.70 112.81 1q86 s GLU 74 Ca -0.03 0.83 0.00 0.00 0.02 0.00 0.00 54.97 55.78 1q86 s GLU 74 Cb 0.08 0.33 0.00 0.00 0.10 0.00 0.00 34.13 34.64 1q86 s GLU 74 CO 0.26 -0.08 0.00 0.41 0.02 0.00 0.00 175.26 175.87 1q86 n GLY 75 N 2.79 0.57 0.19 -1.39 0.00 -1.26 -4.79 105.19 101.31 1q86 n GLY 75 Ca -0.14 -1.90 -0.16 0.00 0.00 0.00 0.00 46.02 43.83 1q86 n GLY 75 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1q86 h ASP 76 N 0.00 0.74 0.00 1.61 3.32 -2.01 -3.40 116.42 116.68 1q86 h ASP 76 Ca 0.00 -0.54 0.00 0.00 0.02 0.00 0.00 57.03 56.51 1q86 h ASP 76 Cb 0.00 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 39.33 1q86 h ASP 76 CO 0.00 1.33 0.00 0.00 -1.72 0.00 0.00 179.24 178.85 1q86 n ALA 77 N -2.58 -0.01 -2.23 3.45 0.00 -1.26 -4.82 120.51 113.06 1q86 n ALA 77 Ca -0.07 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 52.95 1q86 n ALA 77 Cb 0.80 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 20.21 1q86 n ALA 77 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1q86 s ASP 78 N 0.00 7.23 -0.80 0.00 -0.00 -1.26 -4.37 116.67 117.47 1q86 s ASP 78 Ca 0.00 2.02 -0.19 0.00 -0.00 0.00 0.00 52.55 54.39 1q86 s ASP 78 Cb 0.00 -2.59 0.13 0.00 -0.00 0.00 0.00 42.92 40.46 1q86 s ASP 78 CO 0.00 -0.29 0.95 -0.69 -0.00 0.00 0.00 175.17 175.14 1q86 s VAL 79 N 0.24 4.83 0.49 -1.27 1.01 -1.26 -4.74 120.40 119.70 1q86 s VAL 79 Ca 0.52 -1.40 0.03 0.00 0.00 0.00 0.00 61.98 61.12 1q86 s VAL 79 Cb -0.28 -4.65 0.03 0.00 0.00 0.00 0.00 36.38 31.47 1q86 s VAL 79 CO 0.33 -1.34 0.21 -0.90 0.00 0.00 0.00 175.10 173.39 1q86 n ASP 80 N 6.27 2.92 -0.12 3.32 5.68 -1.26 -4.48 116.55 128.88 1q86 n ASP 80 Ca 0.11 -2.88 -0.06 0.00 -0.50 0.00 0.00 54.79 51.46 1q86 n ASP 80 Cb 0.47 0.12 0.01 0.00 -1.14 0.00 0.00 41.12 40.58 1q86 n ASP 80 CO 0.00 0.00 0.00 0.44 -1.33 0.00 0.00 177.20 176.31 1q86 h ASP 81 N 0.83 -0.74 -0.48 -1.12 3.32 -1.94 0.34 116.42 116.64 1q86 h ASP 81 Ca -0.35 0.16 0.06 0.00 0.02 0.00 0.00 57.03 56.92 1q86 h ASP 81 Cb 1.17 0.39 -0.05 0.00 0.22 0.00 0.00 39.33 41.06 1q86 h ASP 81 CO 0.57 -0.25 0.17 -0.08 -1.72 0.00 0.00 179.24 177.93 1q86 h GLU 82 N -0.14 0.33 0.45 3.56 4.81 -1.96 0.45 114.58 122.07 1q86 h GLU 82 Ca 0.20 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.40 1q86 h GLU 82 Cb 0.45 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.74 1q86 h GLU 82 CO -0.50 0.22 -0.34 2.35 -0.73 0.00 0.00 179.01 180.02 1q86 h TRP 83 N 0.34 -0.89 -0.70 0.92 7.01 -1.46 0.18 115.95 121.35 1q86 h TRP 83 Ca 0.23 -0.00 0.15 0.00 2.11 0.00 0.00 58.89 61.37 1q86 h TRP 83 Cb 0.23 0.33 -0.13 0.00 -2.10 0.00 0.00 29.16 27.50 1q86 h TRP 83 CO -0.16 -0.49 -0.10 0.28 -2.79 0.00 0.00 178.44 175.18 1q86 h VAL 84 N -0.77 0.34 0.05 2.65 2.07 0.38 -0.12 116.25 120.85 1q86 h VAL 84 Ca -0.04 -0.01 -0.00 0.00 0.82 0.00 0.00 66.70 67.46 1q86 h VAL 84 Cb 0.66 0.29 0.00 0.00 -1.52 0.00 0.00 31.29 30.72 1q86 h VAL 84 CO 0.01 0.01 -0.02 0.00 0.02 0.00 0.00 177.57 177.58 1q86 h ALA 85 N 1.68 -0.07 0.00 1.67 0.00 0.38 0.61 119.26 123.53 1q86 h ALA 85 Ca 0.36 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1q86 h ALA 85 Cb 0.58 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.39 1q86 h ALA 85 CO -0.68 -0.38 0.00 0.39 0.00 0.00 0.00 179.25 178.59 1q86 n GLU 86 N -4.97 0.28 0.00 0.00 1.02 0.60 -3.82 120.64 113.76 1q86 n GLU 86 Ca -0.08 0.10 0.00 0.00 -0.02 0.00 0.00 57.16 57.15 1q86 n GLU 86 Cb 0.19 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.11 1q86 n GLU 86 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 1q86 n HIS 87 N -1.28 0.00 -4.21 -0.32 8.25 -0.10 -5.06 115.22 112.50 1q86 n HIS 87 Ca 0.09 0.00 -0.29 0.00 -0.26 0.00 0.00 57.72 57.27 1q86 n HIS 87 Cb 0.16 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.24 1q86 n HIS 87 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 1q86 s THR 88 N -1.56 1.46 -0.30 1.59 2.01 0.21 -4.91 115.64 114.14 1q86 s THR 88 Ca 0.00 -1.68 0.26 0.00 0.31 0.00 0.00 61.69 60.58 1q86 s THR 88 Cb 0.00 -2.14 0.35 0.00 0.01 0.00 0.00 72.50 70.72 1q86 s THR 88 CO 0.00 0.00 1.70 0.44 -0.69 0.00 0.00 174.62 176.07 1q86 h ASP 89 N 0.97 0.00 -3.32 3.53 3.32 -1.88 -3.45 116.42 115.58 1q86 h ASP 89 Ca -0.39 0.00 -0.45 0.00 0.02 0.00 0.00 57.03 56.20 1q86 h ASP 89 Cb 1.31 0.00 0.09 0.00 0.22 0.00 0.00 39.33 40.94 1q86 h ASP 89 CO 0.63 0.00 0.20 -0.31 -1.72 0.00 0.00 179.24 178.05 1q86 s TYR 90 N -3.32 2.47 -0.13 4.55 1.51 -1.26 -5.03 117.35 116.14 1q86 s TYR 90 Ca 0.06 0.23 0.20 0.00 -1.01 0.00 0.00 57.07 56.54 1q86 s TYR 90 Cb 0.06 -3.22 -0.29 0.00 -0.11 0.00 0.00 41.96 38.39 1q86 s TYR 90 CO 0.64 -1.57 0.48 -0.25 -1.11 0.00 0.00 175.55 173.74 1q86 n ASP 91 N -2.94 0.55 -3.47 2.29 8.00 -1.26 -4.14 116.55 115.58 1q86 n ASP 91 Ca 0.10 -0.11 -0.06 0.00 0.71 0.00 0.00 54.79 55.43 1q86 n ASP 91 Cb 0.60 1.80 0.00 0.00 -0.02 0.00 0.00 41.12 43.50 1q86 n ASP 91 CO 0.00 0.00 0.00 1.51 -0.39 0.00 0.00 177.20 178.32 1q86 s ASP 92 N -4.10 -0.12 0.20 -2.24 -4.77 -1.26 -4.13 116.67 100.25 1q86 s ASP 92 Ca -0.06 -0.74 -0.13 0.00 -3.30 0.00 0.00 52.55 48.32 1q86 s ASP 92 Cb 0.13 0.68 0.22 0.00 -1.09 0.00 0.00 42.92 42.86 1q86 s ASP 92 CO 0.81 -1.31 1.68 0.40 0.70 0.00 0.00 175.17 177.46 1q86 h ILE 93 N 2.00 0.58 -0.73 2.11 2.04 -1.86 0.13 117.51 121.78 1q86 h ILE 93 Ca -0.26 -0.04 0.05 0.00 1.00 0.00 0.00 64.86 65.61 1q86 h ILE 93 Cb 1.24 0.45 -0.04 0.00 -0.74 0.00 0.00 36.82 37.72 1q86 h ILE 93 CO 0.31 0.02 0.48 0.28 0.00 0.00 0.00 178.15 179.25 1q86 h SER 94 N 0.12 0.72 -0.70 1.72 0.02 -1.96 0.51 113.55 113.98 1q86 h SER 94 Ca 0.27 -0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 61.19 1q86 h SER 94 Cb 0.42 -0.16 -0.03 0.00 0.14 0.00 0.00 62.40 62.77 1q86 h SER 94 CO -0.44 0.48 0.32 1.23 -1.14 0.00 0.00 176.83 177.28 1q86 h GLY 95 N 0.83 1.10 0.60 -3.77 0.00 -1.40 -0.56 103.07 99.87 1q86 h GLY 95 Ca 0.30 -0.57 -0.02 0.00 0.00 0.00 0.00 47.33 47.05 1q86 h GLY 95 CO -0.10 0.54 -0.17 -2.00 0.00 0.00 0.00 176.54 174.81 1q86 h LEU 96 N 0.99 -0.40 -0.50 3.11 5.85 -0.03 -2.88 115.31 121.44 1q86 h LEU 96 Ca 0.24 -0.16 0.08 0.00 0.84 0.00 0.00 57.88 58.88 1q86 h LEU 96 Cb 0.15 0.10 -0.10 0.00 0.37 0.00 0.00 40.66 41.19 1q86 h LEU 96 CO -0.03 0.00 -0.43 0.00 -0.34 0.00 0.00 178.44 177.64 1q86 h ALA 97 N -0.46 -0.37 -0.81 1.25 0.00 0.02 0.20 119.26 119.08 1q86 h ALA 97 Ca -0.05 0.09 0.19 0.00 0.00 0.00 0.00 54.91 55.14 1q86 h ALA 97 Cb 0.53 0.93 -0.12 0.00 0.00 0.00 0.00 17.79 19.13 1q86 h ALA 97 CO 0.08 -0.84 0.27 0.35 0.00 0.00 0.00 179.25 179.10 1q86 h PHE 98 N -0.27 0.43 -0.63 0.00 3.57 -1.14 0.96 116.94 119.86 1q86 h PHE 98 Ca 0.16 0.04 -0.02 0.00 3.53 0.00 0.00 57.97 61.68 1q86 h PHE 98 Cb 0.57 -0.06 -0.03 0.00 2.79 0.00 0.00 35.95 39.22 1q86 h PHE 98 CO -0.67 -0.07 0.30 0.00 -2.23 0.00 0.00 178.31 175.64 1q86 h ALA 99 N 1.66 0.81 0.84 2.41 0.00 -0.46 -0.48 119.26 124.05 1q86 h ALA 99 Ca 0.48 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 55.22 1q86 h ALA 99 Cb 0.87 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.41 1q86 h ALA 99 CO -0.53 0.37 -0.45 -0.07 0.00 0.00 0.00 179.25 178.58 1q86 h LEU 100 N 0.86 -1.10 -0.85 0.00 3.38 0.89 -0.32 115.31 118.18 1q86 h LEU 100 Ca 0.22 0.05 0.16 0.00 0.09 0.00 0.00 57.88 58.39 1q86 h LEU 100 Cb 0.12 0.30 -0.10 0.00 0.09 0.00 0.00 40.66 41.07 1q86 h LEU 100 CO -0.03 -0.73 0.42 -0.07 0.09 0.00 0.00 178.44 178.12 1q86 h LEU 101 N -1.19 0.48 0.00 1.67 3.38 -1.13 0.65 115.31 119.17 1q86 h LEU 101 Ca -0.11 0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1q86 h LEU 101 Cb 0.93 0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.71 1q86 h LEU 101 CO 0.16 0.18 0.00 -1.54 0.09 0.00 0.00 178.44 177.33 1q86 n SER 102 N -4.91 0.00 -3.97 -0.43 3.41 -0.20 -4.47 113.62 103.06 1q86 n SER 102 Ca 0.18 -1.40 -0.26 0.00 -0.26 0.00 0.00 58.87 57.13 1q86 n SER 102 Cb 0.47 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.40 1q86 n SER 102 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1q86 n GLU 103 N -0.71 -3.07 -0.05 4.33 1.02 0.23 -4.88 120.64 117.52 1q86 n GLU 103 Ca 0.09 0.38 0.02 0.00 -0.02 0.00 0.00 57.16 57.63 1q86 n GLU 103 Cb 0.04 -4.44 -0.16 0.00 -0.02 0.00 0.00 31.44 26.86 1q86 n GLU 103 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 1q86 n GLU 104 N -4.41 0.73 -4.04 3.49 4.07 -0.22 -5.03 120.64 115.22 1q86 n GLU 104 Ca -0.31 -0.11 -0.14 0.00 -0.06 0.00 0.00 57.16 56.55 1q86 n GLU 104 Cb 0.68 -1.49 -0.03 0.00 -0.06 0.00 0.00 31.44 30.54 1q86 n GLU 104 CO 0.00 0.00 0.00 -0.08 -0.06 0.00 0.00 177.13 176.99 1q86 s THR 105 N -3.01 0.00 0.08 6.31 -1.32 -1.24 -5.06 115.64 111.40 1q86 s THR 105 Ca -0.08 -1.49 0.01 0.00 -1.21 0.00 0.00 61.69 58.92 1q86 s THR 105 Cb 0.10 -2.66 -0.04 0.00 -1.51 0.00 0.00 72.50 68.39 1q86 s THR 105 CO 0.83 0.00 -0.06 0.42 -2.21 0.00 0.00 174.62 173.60 1q86 s THR 106 N -2.96 0.55 0.52 5.08 -4.23 -1.26 -4.52 115.64 108.82 1q86 s THR 106 Ca 0.28 -1.81 0.29 0.00 -1.18 0.00 0.00 61.69 59.27 1q86 s THR 106 Cb -0.01 -1.52 0.47 0.00 1.34 0.00 0.00 72.50 72.77 1q86 s THR 106 CO 0.18 -0.86 1.89 -0.07 -0.54 0.00 0.00 174.62 175.23 1q86 h LEU 107 N 3.18 0.05 0.10 4.79 3.38 -1.92 -1.11 115.31 123.77 1q86 h LEU 107 Ca -0.35 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.62 1q86 h LEU 107 Cb 1.16 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.91 1q86 h LEU 107 CO 0.63 0.02 -0.05 0.03 0.09 0.00 0.00 178.44 179.16 1q86 h ARG 108 N 0.05 -0.12 -0.05 1.13 3.08 -1.88 1.40 114.38 117.99 1q86 h ARG 108 Ca 0.42 0.01 0.01 0.00 0.07 0.00 0.00 59.98 60.49 1q86 h ARG 108 Cb 1.60 0.03 -0.00 0.00 0.08 0.00 0.00 29.97 31.68 1q86 h ARG 108 CO -0.03 0.40 0.54 0.93 -1.07 0.00 0.00 179.97 180.74 1q86 h GLU 109 N -0.84 0.00 -0.35 0.04 5.08 -1.54 1.13 114.58 118.11 1q86 h GLU 109 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1q86 h GLU 109 Cb 0.58 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.83 1q86 h GLU 109 CO 0.02 0.00 0.00 1.04 -1.00 0.00 0.00 179.01 179.07 1q86 n GLN 110 N -2.83 3.19 -2.71 2.33 1.13 -0.95 -4.96 117.38 112.59 1q86 n GLN 110 Ca -0.00 -2.71 -0.14 0.00 -1.94 0.00 0.00 57.00 52.21 1q86 n GLN 110 Cb 0.59 -1.77 0.02 0.00 0.11 0.00 0.00 30.24 29.19 1q86 n GLN 110 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1q86 n GLY 111 N -0.01 -0.09 3.36 1.08 0.00 0.39 -4.76 105.19 105.17 1q86 n GLY 111 Ca 0.20 -0.21 -0.30 0.00 0.00 0.00 0.00 46.02 45.71 1q86 n GLY 111 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1q86 s LEU 112 N -4.39 2.21 0.17 0.99 1.43 0.48 -1.31 118.68 118.26 1q86 s LEU 112 Ca 0.18 -0.60 -0.32 0.00 -1.03 0.00 0.00 54.13 52.36 1q86 s LEU 112 Cb -0.08 -1.29 -0.11 0.00 0.03 0.00 0.00 46.19 44.74 1q86 s LEU 112 CO 0.22 0.25 1.63 -0.55 0.23 0.00 0.00 176.35 178.13 1q86 s SER 113 N -1.35 6.52 0.00 2.29 0.15 0.33 -3.08 113.70 118.55 1q86 s SER 113 Ca 0.12 2.69 0.01 0.00 0.70 0.00 0.00 55.95 59.47 1q86 s SER 113 Cb -0.10 -2.59 0.06 0.00 -1.71 0.00 0.00 66.02 61.67 1q86 s SER 113 CO 0.03 -0.88 0.50 -2.65 1.20 0.00 0.00 173.24 171.44 1q86 n PRO 114 N 4.16 0.03 -4.59 5.44 -0.02 -1.26 -4.59 135.00 134.17 1q86 n PRO 114 Ca 0.15 0.00 -0.31 0.00 -2.02 0.00 0.00 63.50 61.32 1q86 n PRO 114 Cb 0.38 -1.45 -0.17 0.00 -0.02 0.00 0.00 33.50 32.24 1q86 n PRO 114 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1q86 s THR 115 N -2.00 1.81 -0.65 3.45 2.01 -1.26 -4.43 115.64 114.58 1q86 s THR 115 Ca 0.01 -0.83 -0.18 0.00 0.31 0.00 0.00 61.69 61.00 1q86 s THR 115 Cb 0.01 -1.62 0.13 0.00 0.01 0.00 0.00 72.50 71.02 1q86 s THR 115 CO 0.01 0.50 0.72 -0.76 -0.69 0.00 0.00 174.62 174.40 1q86 s LEU 116 N 0.88 5.69 -0.99 4.42 1.43 0.18 -4.72 118.68 125.57 1q86 s LEU 116 Ca -0.07 -1.72 -0.23 0.00 -1.03 0.00 0.00 54.13 51.07 1q86 s LEU 116 Cb -0.15 -2.28 -0.00 0.00 0.03 0.00 0.00 46.19 43.78 1q86 s LEU 116 CO -0.01 -0.99 1.72 -0.13 0.23 0.00 0.00 176.35 177.16 1q86 s ARG 117 N 2.16 3.08 1.11 1.70 0.52 -1.26 -0.49 118.95 125.77 1q86 s ARG 117 Ca 0.13 -0.78 -0.17 0.00 -0.52 0.00 0.00 55.73 54.38 1q86 s ARG 117 Cb -0.22 -5.23 0.25 0.00 0.52 0.00 0.00 34.95 30.28 1q86 s ARG 117 CO 0.02 -2.84 1.15 -0.51 0.02 0.00 0.00 175.30 173.14 1q86 s LEU 118 N 7.60 1.28 0.22 2.53 1.43 -1.03 -4.96 118.68 125.75 1q86 s LEU 118 Ca 0.59 0.66 0.06 0.00 -1.03 0.00 0.00 54.13 54.40 1q86 s LEU 118 Cb -0.03 -2.55 -0.03 0.00 0.03 0.00 0.00 46.19 43.61 1q86 s LEU 118 CO -0.04 -3.62 0.23 -2.28 0.23 0.00 0.00 176.35 170.87 1q86 s HIS 119 N -3.19 3.23 0.58 0.29 5.65 -0.85 -4.84 115.29 116.16 1q86 s HIS 119 Ca 0.70 -0.05 -0.20 0.00 0.25 0.00 0.00 55.06 55.76 1q86 s HIS 119 Cb -0.10 -1.48 -0.04 0.00 -1.18 0.00 0.00 32.58 29.77 1q86 s HIS 119 CO 0.55 0.50 1.16 -2.30 -0.65 0.00 0.00 174.74 174.01 1q86 n PRO 120 N -1.02 1.22 -1.85 2.88 -0.02 -1.26 -4.45 135.00 130.50 1q86 n PRO 120 Ca -0.08 0.46 -0.43 0.00 -2.02 0.00 0.00 63.50 61.44 1q86 n PRO 120 Cb 0.57 -2.36 -0.03 0.00 -0.02 0.00 0.00 33.50 31.66 1q86 n PRO 120 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1q86 s PRO 121 N -2.87 3.72 0.02 0.52 0.04 -1.26 -4.52 135.00 130.65 1q86 s PRO 121 Ca 0.75 2.03 -0.30 0.00 0.04 0.00 0.00 61.00 63.52 1q86 s PRO 121 Cb -0.42 -4.16 -0.08 0.00 0.04 0.00 0.00 34.50 29.88 1q86 s PRO 121 CO 0.47 -1.41 1.78 1.03 0.04 0.00 0.00 177.00 178.90 1q86 s ARG 122 N 5.06 4.17 0.00 4.56 0.52 0.24 0.36 118.95 133.85 1q86 s ARG 122 Ca 0.84 2.40 0.00 0.00 -0.52 0.00 0.00 55.73 58.45 1q86 s ARG 122 Cb -0.32 -3.93 0.00 0.00 0.52 0.00 0.00 34.95 31.22 1q86 s ARG 122 CO 0.34 -0.86 0.00 0.41 0.02 0.00 0.00 175.30 175.21 1q86 n GLY 123 N 4.25 0.74 0.27 -3.53 0.00 -1.26 -4.90 105.19 100.76 1q86 n GLY 123 Ca 0.18 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.23 1q86 n GLY 123 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1q86 n GLY 124 N -2.00 -2.66 3.90 -0.02 0.00 0.16 -5.02 105.19 99.55 1q86 n GLY 124 Ca 0.00 -1.38 -0.22 0.00 0.00 0.00 0.00 46.02 44.42 1q86 n GLY 124 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 1q86 n HIS 125 N -2.49 -2.75 1.82 1.61 1.44 -1.26 -4.95 115.22 108.64 1q86 n HIS 125 Ca -0.02 -1.87 0.00 0.00 -2.01 0.00 0.00 57.72 53.82 1q86 n HIS 125 Cb 0.13 -0.68 0.01 0.00 0.12 0.00 0.00 29.99 29.57 1q86 n HIS 125 CO 0.00 0.00 0.00 -0.25 -2.81 0.00 0.00 176.34 173.28 1q86 n ASP 126 N -2.74 0.23 0.00 4.39 8.00 -1.26 -4.98 116.55 120.19 1q86 n ASP 126 Ca 0.17 -2.00 0.00 0.00 0.71 0.00 0.00 54.79 53.66 1q86 n ASP 126 Cb 0.60 -0.07 0.00 0.00 -0.02 0.00 0.00 41.12 41.63 1q86 n ASP 126 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1q86 n GLY 127 N 0.47 2.44 2.07 0.44 0.00 -1.26 -4.17 105.19 105.19 1q86 n GLY 127 Ca 0.01 -1.73 -0.26 0.00 0.00 0.00 0.00 46.02 44.03 1q86 n GLY 127 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1q86 n VAL 128 N 1.38 2.81 0.00 1.61 0.24 -1.26 -1.22 118.33 121.88 1q86 n VAL 128 Ca 0.00 -3.86 0.00 0.00 -2.04 0.00 0.00 64.34 58.44 1q86 n VAL 128 Cb 0.00 -1.12 0.00 0.00 -1.47 0.00 0.00 33.84 31.25 1q86 n VAL 128 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 1q86 n LYS 129 N -0.77 3.28 -4.15 7.34 5.02 -1.26 -5.02 118.16 122.59 1q86 n LYS 129 Ca 0.48 0.00 -0.16 0.00 -2.02 0.00 0.00 58.31 56.62 1q86 n LYS 129 Cb 0.89 -0.60 -0.11 0.00 -0.02 0.00 0.00 35.03 35.19 1q86 n LYS 129 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 1q86 s HIS 130 N -1.03 1.05 0.12 2.13 3.76 -1.26 -5.07 115.29 114.99 1q86 s HIS 130 Ca 0.00 -0.53 -0.02 0.00 -0.15 0.00 0.00 55.06 54.36 1q86 s HIS 130 Cb 0.00 -0.59 0.03 0.00 1.11 0.00 0.00 32.58 33.13 1q86 s HIS 130 CO 0.00 0.01 0.13 -0.35 -0.85 0.00 0.00 174.74 173.68 1q86 n PRO 131 N 1.08 -0.70 -0.03 8.40 -0.04 -1.26 -1.71 135.00 140.74 1q86 n PRO 131 Ca -0.20 -0.20 -0.15 0.00 -0.04 0.00 0.00 63.50 62.91 1q86 n PRO 131 Cb 0.55 -0.16 -0.10 0.00 -0.04 0.00 0.00 33.50 33.75 1q86 n PRO 131 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1q86 h VAL 132 N -1.37 1.45 0.00 0.52 2.07 -1.59 1.66 116.25 119.00 1q86 h VAL 132 Ca -0.05 -1.76 0.00 0.00 0.82 0.00 0.00 66.70 65.71 1q86 h VAL 132 Cb 0.13 2.43 0.00 0.00 -1.52 0.00 0.00 31.29 32.33 1q86 h VAL 132 CO 0.03 0.50 0.06 0.29 0.02 0.00 0.00 177.57 178.47 1q86 n LYS 133 N -4.46 0.03 -0.15 1.57 5.02 -1.26 -0.47 118.16 118.44 1q86 n LYS 133 Ca -0.09 0.49 0.05 0.00 -2.02 0.00 0.00 58.31 56.74 1q86 n LYS 133 Cb 0.50 -1.66 0.12 0.00 -0.02 0.00 0.00 35.03 33.97 1q86 n LYS 133 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1q86 n GLU 134 N -1.62 2.75 -0.70 1.97 1.02 -1.17 -4.96 120.64 117.94 1q86 n GLU 134 Ca -0.00 -2.06 0.00 0.00 -0.02 0.00 0.00 57.16 55.08 1q86 n GLU 134 Cb 0.07 -1.30 0.00 0.00 -0.02 0.00 0.00 31.44 30.19 1q86 n GLU 134 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1q86 n GLY 135 N -0.17 0.82 0.00 0.62 0.00 0.38 -4.82 105.19 102.01 1q86 n GLY 135 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 1q86 n GLY 135 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1q86 n GLY 136 N -2.10 0.38 0.10 -0.02 0.00 0.56 -4.71 105.19 99.39 1q86 n GLY 136 Ca 0.00 -1.71 0.01 0.00 0.00 0.00 0.00 46.02 44.32 1q86 n GLY 136 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1q86 n GLN 137 N 0.00 0.68 -3.79 1.61 -0.06 -0.36 -4.23 117.38 111.23 1q86 n GLN 137 Ca 0.00 -0.93 -0.31 0.00 -2.00 0.00 0.00 57.00 53.76 1q86 n GLN 137 Cb 0.00 -0.67 -0.04 0.00 -4.06 0.00 0.00 30.24 25.47 1q86 n GLN 137 CO 0.00 0.00 0.00 -0.51 -0.20 0.00 0.00 177.06 176.35 1q86 s LEU 138 N -0.39 4.31 0.00 1.69 1.43 -1.13 -4.61 118.68 119.98 1q86 s LEU 138 Ca 0.02 0.43 0.00 0.00 -1.03 0.00 0.00 54.13 53.55 1q86 s LEU 138 Cb 0.02 -3.14 0.00 0.00 0.03 0.00 0.00 46.19 43.10 1q86 s LEU 138 CO 0.00 0.10 0.00 0.61 0.23 0.00 0.00 176.35 177.29 1q86 n GLY 139 N 0.11 -1.80 3.76 -3.19 0.00 -0.81 -2.05 105.19 101.22 1q86 n GLY 139 Ca -0.04 -1.86 -0.38 0.00 0.00 0.00 0.00 46.02 43.74 1q86 n GLY 139 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1q86 s LYS 140 N 0.00 3.61 0.31 1.61 2.20 -1.26 -2.15 119.74 124.06 1q86 s LYS 140 Ca 0.00 2.00 0.05 0.00 -0.36 0.00 0.00 55.97 57.65 1q86 s LYS 140 Cb 0.00 -2.44 -0.06 0.00 -1.51 0.00 0.00 37.83 33.82 1q86 s LYS 140 CO 0.00 -0.74 0.02 -1.01 -0.36 0.00 0.00 175.35 173.26 1q86 s HIS 141 N -1.41 1.95 0.55 4.03 3.76 0.18 -4.74 115.29 119.61 1q86 s HIS 141 Ca 0.65 -0.87 -0.16 0.00 -0.15 0.00 0.00 55.06 54.52 1q86 s HIS 141 Cb -0.34 -1.22 -0.06 0.00 1.11 0.00 0.00 32.58 32.07 1q86 s HIS 141 CO 0.42 0.10 1.02 -0.51 -0.85 0.00 0.00 174.74 174.92 1q86 s ASP 142 N -3.47 6.22 0.50 1.40 1.01 -1.26 -4.56 116.67 116.52 1q86 s ASP 142 Ca 0.34 1.70 0.19 0.00 0.71 0.00 0.00 52.55 55.49 1q86 s ASP 142 Cb 0.07 -2.52 1.28 0.00 1.01 0.00 0.00 42.92 42.76 1q86 s ASP 142 CO 0.14 -0.86 2.09 0.74 0.21 0.00 0.00 175.17 177.49 1q86 h THR 143 N 0.72 0.92 0.07 -1.27 2.02 -1.98 1.02 112.91 114.41 1q86 h THR 143 Ca -0.47 -0.33 -0.25 0.00 0.77 0.00 0.00 66.41 66.13 1q86 h THR 143 Cb 1.20 1.19 -0.00 0.00 -1.74 0.00 0.00 68.15 68.80 1q86 h THR 143 CO 0.59 0.09 -1.10 -0.08 0.37 0.00 0.00 175.52 175.39 1q86 h GLU 144 N 0.00 0.27 -0.20 6.66 4.81 -1.91 -2.59 114.58 121.62 1q86 h GLU 144 Ca -0.00 -0.39 -0.05 0.00 -0.13 0.00 0.00 59.36 58.79 1q86 h GLU 144 Cb 0.18 0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.69 1q86 h GLU 144 CO 0.01 1.14 -0.07 0.78 -0.73 0.00 0.00 179.01 180.14 1q86 h GLY 145 N 1.65 0.43 0.88 1.92 0.00 -0.90 -2.43 103.07 104.63 1q86 h GLY 145 Ca -0.10 -0.38 -0.01 0.00 0.00 0.00 0.00 47.33 46.84 1q86 h GLY 145 CO 0.18 0.34 0.07 -2.22 0.00 0.00 0.00 176.54 174.91 1q86 h ILE 146 N 0.11 1.17 -0.77 2.60 1.08 0.81 -2.91 117.51 119.59 1q86 h ILE 146 Ca 0.05 -0.51 0.11 0.00 -0.39 0.00 0.00 64.86 64.12 1q86 h ILE 146 Cb 0.54 1.17 -0.08 0.00 -3.07 0.00 0.00 36.82 35.38 1q86 h ILE 146 CO 0.02 0.16 0.39 0.44 -0.69 0.00 0.00 178.15 178.47 1q86 h ASP 147 N 0.13 0.49 0.01 1.72 5.19 -1.47 0.15 116.42 122.64 1q86 h ASP 147 Ca 0.06 0.07 0.02 0.00 -0.62 0.00 0.00 57.03 56.56 1q86 h ASP 147 Cb 0.19 -0.01 -0.03 0.00 0.18 0.00 0.00 39.33 39.66 1q86 h ASP 147 CO -0.00 0.25 -0.13 0.44 -3.12 0.00 0.00 179.24 176.68 1q86 h ASP 148 N 0.62 -0.38 0.90 6.45 3.32 -1.25 0.39 116.42 126.47 1q86 h ASP 148 Ca 0.39 0.06 -0.04 0.00 0.02 0.00 0.00 57.03 57.45 1q86 h ASP 148 Cb 0.47 0.16 0.01 0.00 0.22 0.00 0.00 39.33 40.18 1q86 h ASP 148 CO -0.30 -0.19 -0.43 0.25 -1.72 0.00 0.00 179.24 176.85 1q86 h LEU 149 N -0.23 -1.02 -0.65 1.55 5.85 -1.19 0.34 115.31 119.97 1q86 h LEU 149 Ca 0.04 0.03 0.14 0.00 0.84 0.00 0.00 57.88 58.94 1q86 h LEU 149 Cb 0.28 0.26 -0.12 0.00 0.37 0.00 0.00 40.66 41.46 1q86 h LEU 149 CO -0.12 -0.72 -0.06 -0.07 -0.34 0.00 0.00 178.44 177.13 1q86 h LEU 150 N -1.21 -0.41 -0.57 2.25 3.38 -0.61 -0.03 115.31 118.11 1q86 h LEU 150 Ca -0.12 0.18 -0.02 0.00 0.09 0.00 0.00 57.88 58.01 1q86 h LEU 150 Cb 0.92 0.33 -0.03 0.00 0.09 0.00 0.00 40.66 41.98 1q86 h LEU 150 CO 0.20 -0.16 0.30 -0.33 0.09 0.00 0.00 178.44 178.53 1q86 h GLU 151 N 0.07 0.80 0.00 1.13 5.08 -0.04 -1.85 114.58 119.77 1q86 h GLU 151 Ca 0.34 -0.10 -0.00 0.00 -1.00 0.00 0.00 59.36 58.59 1q86 h GLU 151 Cb 0.55 -0.15 -0.00 0.00 0.50 0.00 0.00 28.75 29.65 1q86 h GLU 151 CO -0.60 0.63 -0.00 0.00 -1.00 0.00 0.00 179.01 178.04 1q86 h ALA 152 N 1.13 1.00 -0.45 3.43 0.00 0.78 -1.44 119.26 123.70 1q86 h ALA 152 Ca 0.20 -0.00 -0.15 0.00 0.00 0.00 0.00 54.91 54.96 1q86 h ALA 152 Cb 0.08 -0.00 -0.09 0.00 0.00 0.00 0.00 17.79 17.78 1q86 h ALA 152 CO -0.03 0.00 0.08 -1.33 0.00 0.00 0.00 179.25 177.97 1q86 n MET 153 N -3.09 2.69 0.00 0.00 2.81 -0.20 -0.59 117.12 118.75 1q86 n MET 153 Ca -0.01 -3.03 0.13 0.00 -1.81 0.00 0.00 57.70 52.98 1q86 n MET 153 Cb 0.20 -1.95 0.76 0.00 -0.71 0.00 0.00 33.22 31.52 1q86 n MET 153 CO 0.00 0.00 0.00 -2.13 1.51 0.00 0.00 175.97 175.35